1-[(3-phenylmethoxyphenyl)-pyridin-2-yl-methyl]-1,4-diazepane

Systemtic Name: 1-[(3-phenylmethoxyphenyl)-pyridin-2-yl-methyl]-1,4-diazepane Openeye Name: 1-[(3-benzyloxyphenyl)-(2-pyridyl)methyl]-1,4-diazepane CAS Name: 1-[(3-phenylmethoxyphenyl)-(2-pyridinyl)methyl]-1,4-diazepane IUPAC Name: 1-[(3-phenylmethoxyphenyl)-pyridin-2-ylmethyl]-1,4-diazepane Traditional Name: 1-[(3-benzoxyphenyl)-(2-pyridyl)methyl]-1,4-diazepane Formula: C24H27N3O MolecularWeight: 373.49068

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Descriptors Computed from Structure

Canonical SMILES:

C1CNCCN(C1)C(C2=CC(=CC=C2)OCC3=CC=CC=C3)C4=CC=CC=N4

Isomeric SMILES

C1CNCCN(C1)C(C2=CC(=CC=C2)OCC3=CC=CC=C3)C4=CC=CC=N4

InChI

InChI=1S/C24H27N3O/c1-2-8-20(9-3-1)19-28-22-11-6-10-21(18-22)24(23-12-4-5-14-26-23)27-16-7-13-25-15-17-27/h1-6,8-12,14,18,24-25H,7,13,15-17,19H2